methyl (4S,5R)-4-[3-bromanyl-4-[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl]oxy-5-methoxy-phenyl]-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: methyl (4S,5R)-4-[3-bromanyl-4-[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl]oxy-5-methoxy-phenyl]-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl (4S,5R)-4-[3-bromo-4-[(1S)-2-ethoxy-1-methyl-2-oxo-ethoxy]-5-methoxy-phenyl]-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-[3-bromo-4-[(2S)-1-ethoxy-1-oxopropan-2-yl]oxy-5-methoxyphenyl]-6-methylene-2-sulfanylidene-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl (4S,5R)-4-[3-bromo-4-[(2S)-1-ethoxy-1-oxopropan-2-yl]oxy-5-methoxyphenyl]-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-4-[3-bromo-4-[(1S)-2-ethoxy-2-keto-1-methyl-ethoxy]-5-methoxy-phenyl]-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C19H23BrN2O6S MolecularWeight: 487.36472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=C(C=C(C=C1Br)C2C(C(=C)NC(=S)N2)C(=O)OC)OC

Isomeric SMILES

CCOC(=O)[C@H](C)OC1=C(C=C(C=C1Br)[C@@H]2[C@H](C(=C)NC(=S)N2)C(=O)OC)OC

InChI

InChI=1S/C19H23BrN2O6S/c1-6-27-17(23)10(3)28-16-12(20)7-11(8-13(16)25-4)15-14(18(24)26-5)9(2)21-19(29)22-15/h7-8,10,14-15H,2,6H2,1,3-5H3,(H2,21,22,29)/t10-,14-,15+/m0/s1